Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM378029
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM378029 |
| SMILES |
N#CC=CN(C=O)CCF
|
| InChIKey |
FQYMSOUWZPMTOR-UHFFFAOYSA-N
|
| MW [Da] |
142.13
Automatically obtained from RDkit software. |
| LogP |
0.45
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM178237
Similarity: 0.8077
Similarity to MM178237
| Tanimoto metric | 0.8077 |
|---|---|
| Cosine metric | 0.8987 |
| Dice metric | 0.8936 |
| MW: | 131.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.95 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM200713
Similarity: 0.75
Similarity to MM200713
| Tanimoto metric | 0.75 |
|---|---|
| Cosine metric | 0.866 |
| Dice metric | 0.8571 |
| MW: | 124.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.5 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM89091
Similarity: 0.6446
Similarity to MM89091
| Tanimoto metric | 0.6446 |
|---|---|
| Cosine metric | 0.7847 |
| Dice metric | 0.7839 |
| MW: | 135.13 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.01 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+209 more
